N-(2-fluorophenyl)-4-{[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-4-{[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide
N-(2-fluorophenyl)-4-{[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide
Compound characteristics
Compound ID: | G768-1557 |
Compound Name: | N-(2-fluorophenyl)-4-{[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide |
Molecular Weight: | 470.55 |
Molecular Formula: | C21 H19 F N6 O2 S2 |
Smiles: | C1CN(CCN1CC1=CC(N2C(=N1)SC(c1cccs1)=N2)=O)C(Nc1ccccc1F)=O |
Stereo: | ACHIRAL |
logP: | 2.6839 |
logD: | 2.5993 |
logSw: | -3.0862 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.601 |
InChI Key: | NHWFCRHGRANAOA-UHFFFAOYSA-N |